ethyl 4-[4-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-3-(3-phenylpropyl)-2-sulfanylidene-imidazolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-3-(3-phenylpropyl)-2-sulfanylidene-imidazolidin-1-yl]benzoate Openeye Name: ethyl 4-[4-[2-(4-ethoxyanilino)-2-oxo-ethyl]-5-oxo-3-(3-phenylpropyl)-2-thioxo-imidazolidin-1-yl]benzoate CAS Name: 4-[4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-3-(3-phenylpropyl)-2-sulfanylidene-1-imidazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-3-(3-phenylpropyl)-2-sulfanylideneimidazolidin-1-yl]benzoate Traditional Name: 4-[5-keto-4-[2-keto-2-(p-phenetidino)ethyl]-3-(3-phenylpropyl)-2-thioxo-imidazolidin-1-yl]benzoic acid ethyl ester Formula: C31H33N3O5S MolecularWeight: 559.67582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C31H33N3O5S/c1-3-38-26-18-14-24(15-19-26)32-28(35)21-27-29(36)34(25-16-12-23(13-17-25)30(37)39-4-2)31(40)33(27)20-8-11-22-9-6-5-7-10-22/h5-7,9-10,12-19,27H,3-4,8,11,20-21H2,1-2H3,(H,32,35)